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Langmuir, Vol.14, No.21, 6328-6331, 1998
Prediction of gas mixture adsorption on activated carbon using molecular simulations
Keywords:DENSITY-FUNCTIONAL THEORY;MONTE-CARLO SIMULATIONS;PORE-SIZEDISTRIBUTION;LENNARD-JONES MIXTURES;SLIT PORES;NITROGENADSORPTION;METHANE;MODEL;EQUILIBRIUM;DIOXIDE